Compile Data Set for Download or QSAR
Found 11 of ki for UniProtKB: P04799
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50027793(CHEMBL3215311)copy SMILEScopy InChI
Affinity DataKi:  4nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2 measured by 7-methoxyresorufin O-demethylation (MROD)More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50214612(2-(1-propynyl)phenanthrene | CHEMBL253346)copy SMILEScopy InChI
Affinity DataKi:  30nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50027784(9-Ethynyl Phenanthrene | CHEMBL1908227)copy SMILEScopy InChI
Affinity DataKi:  30nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2 measured by 7-methoxyresorufin O-demethylation (MROD)More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50027776(4-Ethynyl Biphenyl | 4-Ethynyl-Biphenyl | CHEMBL37...)copy SMILEScopy InChI
Affinity DataKi:  870nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2 measured by 7-methoxyresorufin O-demethylation (MROD)More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50027779(4-Ethynyl Pyrene | CHEMBL1908231)copy SMILEScopy InChI
Affinity DataKi:  1.20E+3nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2 measured by 7-methoxyresorufin O-demethylation (MROD)More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50088435(CHEMBL3274190)copy SMILEScopy InChI
Affinity DataKi:  4.70E+3nMAssay Description:Competitive inhibition of rat recombinant CYP1A2 expressed in Escherichia coli assessed as inhibition of PHEN O-deethylation by dixon plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3VGWPubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50448435(CHEMBL3122088)copy SMILEScopy InChI
Affinity DataKi:  1.36E+4nMAssay Description:Competitive inhibition of rat recombinant CYP1A2 expressed in Escherichia coli assessed as inhibition of PHEN O-deethylation by dixon plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3VGWPubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50448437(CHEMBL3122151 | Oleate)copy SMILEScopy InChI
Affinity DataKi:  1.67E+4nMAssay Description:Competitive inhibition of rat recombinant CYP1A2 expressed in Escherichia coli assessed as inhibition of PHEN O-deethylation by dixon plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3VGWPubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50071058((2R,4aS,6aS,12bR,14aS,14bR)-10-Hydroxy-2,4a,6a,9,1...)copy SMILEScopy InChI
Affinity DataKi:  3.92E+4nMMore data for this Ligand-Target Pair
In DepthDetails
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50028091((1E)-5-methoxy-1-[4-(trifluoromethyl)phenyl]pentan...)copy SMILEScopy InChI
Affinity DataKi:  5.74E+4nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A2 measured by zolmitriptan metabolismMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VQ33X3PubMed
TargetCytochrome P450 1A2(Rattus norvegicus)
F. Hoffmann-La Roche Ltd.

Curated by ChEMBL
LigandPNGBDBM50592756(CHEMBL5182450)copy SMILES
Affinity DataKi:  1.27E+5nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DJ5KMVPubMed